REMARK  Name = BDB034382
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.175  -0.070  -2.293  0.00  0.00    +0.083 C 
ENDROOT
BRANCH   1   2
ATOM      2  N   LIG    1       -0.313   1.384  -2.284  0.00  0.00    -0.312 NA
ATOM      3  H   LIG    1        0.207   1.779  -3.067  0.00  0.00    +0.122 HD
BRANCH   2   4
ATOM      4  C   LIG    1       -1.707   1.831  -2.396  0.00  0.00    +0.120 C 
BRANCH   4   7
ATOM      5  C   LIG    1       -4.049   0.342   0.256  0.00  0.00    -0.041 A 
ATOM      6  C   LIG    1       -3.308   0.542  -0.923  0.00  0.00    +0.012 A 
ATOM      7  C   LIG    1       -2.499   1.681  -1.117  0.00  0.00    +0.008 A 
ATOM      8  C   LIG    1       -2.446   2.640  -0.103  0.00  0.00    +0.121 A 
ATOM      9  C   LIG    1       -3.168   2.473   1.074  0.00  0.00    +0.046 A 
ATOM     10  C   LIG    1       -3.958   1.335   1.249  0.00  0.00    +0.008 A 
BRANCH   5  12
ATOM     11  C   LIG    1       -4.920  -1.899  -0.696  0.00  0.00    +0.015 C 
ATOM     12  C   LIG    1       -4.928  -0.901   0.484  0.00  0.00    -0.013 C 
ATOM     13  C   LIG    1       -4.432  -1.665   1.731  0.00  0.00    +0.015 C 
ATOM     14  C   LIG    1       -6.393  -0.467   0.704  0.00  0.00    +0.015 C 
ENDBRANCH   5  12
BRANCH   8  15
ATOM     15  O   LIG    1       -1.687   3.763  -0.282  0.00  0.00    -0.506 OA
ATOM     16  H   LIG    1       -1.689   4.275   0.542  0.00  0.00    +0.292 HD
ENDBRANCH   8  15
ENDBRANCH   4   7
ENDBRANCH   2   4
ENDBRANCH   1   2
BRANCH   1  17
ATOM     17  C   LIG    1        1.290  -0.475  -2.111  0.00  0.00    +0.034 C 
BRANCH  17  18
ATOM     18  C   LIG    1        1.836  -0.069  -0.739  0.00  0.00    +0.103 C 
BRANCH  18  19
ATOM     19  N   LIG    1        3.193  -0.600  -0.586  0.00  0.00    -0.343 N 
ATOM     20  H   LIG    1        3.770  -0.390  -1.398  0.00  0.00    +0.146 HD
BRANCH  19  21
ATOM     21  C   LIG    1        3.919  -0.355   0.600  0.00  0.00    +0.038 A 
ATOM     22  C   LIG    1        5.284  -0.756   0.693  0.00  0.00    +0.021 A 
ATOM     23  C   LIG    1        5.969  -0.506   1.908  0.00  0.00    +0.074 A 
ATOM     24  C   LIG    1        7.304  -0.864   2.026  0.00  0.00    +0.048 A 
ATOM     25  C   LIG    1        7.984  -1.478   0.978  0.00  0.00    +0.043 A 
ATOM     26  C   LIG    1        7.332  -1.753  -0.214  0.00  0.00    +0.021 A 
ATOM     27 CL   LIG    1        9.639  -1.910   1.166  0.00  0.00    -0.083 Cl
ATOM     28  N   LIG    1        5.384   0.059   2.973  0.00  0.00    -0.255 NA
ATOM     29  C   LIG    1        4.080   0.376   2.876  0.00  0.00    +0.113 A 
ATOM     30  C   LIG    1        5.991  -1.397  -0.355  0.00  0.00    +0.013 A 
ATOM     31  C   LIG    1        3.317   0.181   1.740  0.00  0.00    +0.043 A 
ENDBRANCH  19  21
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH   1  17
TORSDOF 9